ethyl (2S)-2-(1-benzofuran-2-ylcarbonylamino)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethanoate

Systemtic Name: ethyl (2S)-2-(1-benzofuran-2-ylcarbonylamino)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)ethanoate Openeye Name: ethyl (2S)-2-(benzofuran-2-carbonylamino)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)acetate CAS Name: (2S)-2-[[2-benzofuranyl(oxo)methyl]amino]-2-(3,5-dimethyl-1-phenyl-4-pyrazolyl)acetic acid ethyl ester IUPAC Name: ethyl (2S)-2-(1-benzofuran-2-carbonylamino)-2-(3,5-dimethyl-1-phenylpyrazol-4-yl)acetate Traditional Name: (2S)-2-(benzofuran-2-carbonylamino)-2-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)acetic acid ethyl ester Formula: C24H23N3O4 MolecularWeight: 417.45712

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=C(N(N=C1C)C2=CC=CC=C2)C)NC(=O)C3=CC4=CC=CC=C4O3

Isomeric SMILES

CCOC(=O)[C@H](C1=C(N(N=C1C)C2=CC=CC=C2)C)NC(=O)C3=CC4=CC=CC=C4O3

InChI

InChI=1S/C24H23N3O4/c1-4-30-24(29)22(25-23(28)20-14-17-10-8-9-13-19(17)31-20)21-15(2)26-27(16(21)3)18-11-6-5-7-12-18/h5-14,22H,4H2,1-3H3,(H,25,28)/t22-/m0/s1